Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | NCF1 | P14598 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | GPR3 | P46089 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28708579 | 0.98 | CYP1A2 (0.51) | CYP1A2RAB9ANCF1KDM4ELMNA | |
| SCHEMBL21834809 | 0.98 | CYP1A2 (0.51) | CYP1A2RAB9ANCF1KDM4ELMNA | |
| SCHEMBL30524345 | 0.82 | CAMKK1 (0.46) | CYP1A2RAB9ANCF1TDP1L3MBTL1 | |
| SCHEMBL20809293 | 0.82 | DHODH (0.46) | RAB9ANCF1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL28709641 | 0.82 | CAMKK1 (0.46) | CYP1A2RAB9ANCF1TDP1L3MBTL1 | |
| SCHEMBL20809296 | 0.82 | DHODH (0.54) | CYP1A2KDM4ELMNASMN1; SMN2TDP1 | |
| SCHEMBL20809084 | 0.81 | DHODH (0.48) | RAB9ANCF1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL28714760 | 0.81 | LMNA (0.50) | CYP1A2RAB9AKDM4ELMNASMN1; SMN2 | |
| SCHEMBL20809082 | 0.81 | DHODH (0.56) | KDM4ELMNASMN1; SMN2TDP1L3MBTL1 | |
| SCHEMBL23046750 | 0.80 | TYMS (0.41) | CYP1A2RAB9ANCF1KDM4ELMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114277389-B | Method for synthesizing quinoline derivative by utilizing pyridinium photoelectrocatalysis Minisci reaction | 齐鲁工业大学 | 2023-09-19 | — | — | CN | disclosed |
| CN-114277389-A | Method for synthesizing quinoline derivative by utilizing pyridinium photoelectrocatalysis Minisci reaction | 齐鲁工业大学 | 2022-04-05 | — | — | CN | disclosed |